Vitas-M small molecule compound
(2E)-4-[(3-carbamoyl-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)amino]-4-oxobut-2-enoic acid
Catalog ID
STK316080
SMILES OC(=O)/C=C/C(=O)Nc1sc2c(c1C(=O)N)CCC2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C12H12N2O4S MW 280.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O4S/c13-11(18)10-6-2-1-3-7(6)19-12(10)14-8(15)4-5-9(16)17/h4-5H,1-3H2,(H2,13,18)(H,14,15)(H,16,17)/b5-4+InChIKey
IBRIYRXUASBBOC-SNAWJCMRSA-NSynonyms
444923-94-8(2E)3(N(3CARBAMOYL(456TRIHYDROCYCLOPENTA(21D)THIOPHEN2YL))CARBAMOYL)PROP2ENOICACID
(2E)4((3carbamoyl56dihydro4Hcyclopenta(b)thiophen2yl)amino)4oxobut2enoicacid
(E)4((3CARBAMOYL56DIHYDRO4HCYCLOPENTA(B)THIOPHEN2YL)AMINO)4OXOBUT2ENOICACID
4((3(AMINOCARBONYL)56DIHYDRO4HCYCLOPENTA(B)THIEN2YL)AMINO)4OXO2BUTENOICACID
444923948
C1CC2=C(C1)SC(=C2C(=O)N)NC(=O)C=CC(=O)O
InChI=1SC12H12N2O4Sc1311(18)1062137(6)1912(10)148(15)459(16)17h45H13H2(H21318)(H1415)(H1617)b54+
MFCD02254173
OC(=O)C=CC(=O)Nc1sc2c(c1C(=O)N)CCC2
ZINC000004614959
ZINC4614959
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